SCHEMBL9835764

SCHEMBL9835764

CCCCCCCCCC(=O)N(CCC)OCCCCCC

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 1/20 0.45
DGKA P23743 1/20 0.44
CES2 O00748 3/20 0.42
CES1 P23141 3/20 0.42
KDM5A P29375 1/20 0.41
GPR84 Q9NQS5 7/20 0.41
PPARG P37231 6/20 0.41
PPARD Q03181 6/20 0.41
PPARA Q07869 6/20 0.41
HDAC11 Q96DB2 5/20 0.41
TSHR P16473 4/20 0.41
ALDH1A1 P00352 2/20 0.41
TLR2 O60603 2/20 0.41
TDP1 Q9NUW8 2/20 0.41
FABP4 P15090 2/20 0.41
PTPN1 P18031 2/20 0.41
SLC22A6 Q4U2R8 1/20 0.41
SLC22A8 Q8TCC7 1/20 0.41
MEN1 O00255 1/20 0.41
ESR1 P03372 1/20 0.41

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL9835279 0.89 DNM1 (0.45) DNM1DGKACES2CES1KDM5A
SCHEMBL28002571 0.88 DNM1 (0.41) DNM1DGKACES2CES1KDM5A
SCHEMBL9836289 0.88 EPHX2 (0.41) DNM1PPARGPPARDPPARATDP1
SCHEMBL9837471 0.87 DGKA (0.46) DNM1DGKACES2CES1GPR84
SCHEMBL9836452 0.86 DNM1 (0.45) DNM1DGKACES2CES1KDM5A
SCHEMBL27519107 0.81 KDM5A (0.46) CES2CES1KDM5AGPR84PPARG
SCHEMBL2122727 0.79 ALDH1A1 (0.39) DNM1DGKATSHRALDH1A1TDP1
SCHEMBL9003370 0.79 CES2 (0.42) DNM1CES2CES1KDM5AGPR84
SCHEMBL27547411 0.77 KDM5A (0.54) KDM5AGPR84PPARGPPARDPPARA
SCHEMBL9836722 0.76 CES2 (0.46) DGKACES2CES1GPR84PPARG

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0200377-B1 HYDROXAMATES SQUIBB & SONS INC (US) 1991-10-09 EP disclosed
EP-0200377-A2 Hydroxamates E.R. Squibb & Sons, Inc. (US) 1986-11-05 EP disclosed
US-4604407-A Hydroxamates E. R. SQUIBB & SONS, INC. (US) 1986-08-05 US disclosed